methyl (2R,3R)-2-bromanyl-3-oxidanyl-dodecanoate

Systemtic Name: methyl (2R,3R)-2-bromanyl-3-oxidanyl-dodecanoate Openeye Name: methyl (2R,3R)-2-bromo-3-hydroxy-dodecanoate CAS Name: (2R,3R)-2-bromo-3-hydroxydodecanoic acid methyl ester IUPAC Name: methyl (2R,3R)-2-bromo-3-hydroxydodecanoate Traditional Name: (2R,3R)-2-bromo-3-hydroxy-lauric acid methyl ester Formula: C13H25BrO3 MolecularWeight: 309.2398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(C(C(=O)OC)Br)O

Isomeric SMILES

CCCCCCCCC[C@H]([C@H](C(=O)OC)Br)O

InChI

InChI=1S/C13H25BrO3/c1-3-4-5-6-7-8-9-10-11(15)12(14)13(16)17-2/h11-12,15H,3-10H2,1-2H3/t11-,12-/m1/s1